- InChI
- InChI=1S/C15H22O/c1-2-3-4-5-6-10-13-15(16)14-11-8-7-9-12-14/h7-9,11-12H,2-6,10,13H2,1H3
- InChI Key
- PFUPABFCHVRLLY-UHFFFAOYSA-N
- Formula
- C15H22O
- SMILES
- CCCCCCCCC(=O)c1ccccc1
- Molecular Weight1
- 218.33
- CAS
- 6008-36-2
- Other Names
-
- n-Nonanophenone
- 1-Nonanone, 1-phenyl-
- 1-Phenyl-1-nonanone
- 1-Phenylnonan-1-one
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- IE : Ionization energy (eV).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Inp : Non-polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ω | 0.6810 | Relay (1.0) Calculated Property | |
| ΔfG° | 58.91 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -237.77 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 30.25 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 80.99 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.14 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.27 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.620 | Crippen Calculated Property | |
| McVol | 200.020 | ml/mol | McGowan Calculated Property |
| Pc | 1950.95 | kPa | Joback Calculated Property |
| Inp | [1794.00; 1794.00] |
|
|
| Inp | 1794.00 | NIST | |
| Inp | 1794.00 | NIST | |
| Tboil | 574.45 | K | Relay (1.0) Calculated Property |
| Tc | 777.89 | K | Relay (1.0) Calculated Property |
| Tfus | 299.53 | K | Relay (1.0) Calculated Property |
| Vc | 0.756 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [518.45; 607.76] | J/mol×K | [623.15; 822.26] |
|
| Cp,gas | 518.45 | J/mol×K | 623.15 | Joback Calculated Property |
| Cp,gas | 535.64 | J/mol×K | 656.33 | Joback Calculated Property |
| Cp,gas | 551.85 | J/mol×K | 689.52 | Joback Calculated Property |
| Cp,gas | 567.13 | J/mol×K | 722.70 | Joback Calculated Property |
| Cp,gas | 581.52 | J/mol×K | 755.89 | Joback Calculated Property |
| Cp,gas | 595.04 | J/mol×K | 789.07 | Joback Calculated Property |
| Cp,gas | 607.76 | J/mol×K | 822.26 | Joback Calculated Property |
| η | [0.0001729; 0.0027358] | Pa×s | [335.16; 623.15] |
|
| η | 0.0027358 | Pa×s | 335.16 | Joback Calculated Property |
| η | 0.0012943 | Pa×s | 383.16 | Joback Calculated Property |
| η | 0.0007234 | Pa×s | 431.16 | Joback Calculated Property |
| η | 0.0004543 | Pa×s | 479.15 | Joback Calculated Property |
| η | 0.0003105 | Pa×s | 527.15 | Joback Calculated Property |
| η | 0.0002261 | Pa×s | 575.15 | Joback Calculated Property |
| η | 0.0001729 | Pa×s | 623.15 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to n-Octyl phenyl ketone.
Sources
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